[CPMD-list] Please help with NLCC in Dfhipp and Gianozzi's program

LAMAS, EDUARDO JORGE LAMAS at engr.sc.edu
Thu Jul 24 21:24:13 CEST 2003


Dear All: 

  I was plotting the rho from the nonlinear core corrections that comes
as an output

from Gianozzi's PP generation program and comparing it with the one
generated by

Dfhipp program.

 

But when plotting both functions I found the same shape and the same 

decay but with a factor of about 30 in the y access. 

 

Could somebody please explain me what that factor is?

 

Thanks in advance,

 

Eduardo

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